2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine
TL;DR: 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine (CAS 353779-53-0) is a chemical compound with molecular formula C18H22ClNO3 and molecular weight 335.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine
Also Known As: BAS 01125332, 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine, AB00089580-01, 4-Chloro-N-[(2,3,4-trimethoxyphenyl)methyl]benzeneethanamine, BRD-K49909194-001-01-4
| Molecular Formula | C18H22ClNO3 |
|---|---|
| Molecular Weight | 335.13 g/mol |
| LogP | 3.6981 |
| Topological Polar Surface Area | 39.72 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 335.1288 |
| Heavy Atoms | 23 |
| Complexity | 628.909 |
Chemical Identifiers
| CAS Number | 353779-53-0 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)CNCCC2=CC=C(C=C2)Cl)OC)OC |
Product Overview
2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine (CAS 353779-53-0), with molecular formula C18H22ClNO3 and molecular weight 335.13 g/mol. IUPAC: 2-(4-chlorophenyl)-N-[(2,3,4-trimethoxyphenyl)methyl]ethanamine.
Chemical Property Profile of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine
Property Insights of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine
The XLogP value of 3.6981 indicates that 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.72 Ų, 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
The CAS number of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine is 353779-53-0.
What is the molecular formula of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
The molecular formula of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine is C18H22ClNO3.
What is the molecular weight of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
The molecular weight of 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine is 335.13 g/mol.
Where can I buy 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
You can request a quote for 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-chlorophenyl)-N-(2,3,4-trimethoxybenzyl)ethanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.